(1S,4S,5S,16S,19R,23R)-4,5,24,24-Tetramethyl-25,26-Dioxa-7-Azaheptacyclo[21.2.1.0~1,20~.0~4,19~.0~5,16~.0~6,14~.0~8,13~]Hexacosa-6(14),8,10,12,20-Pentaen-22-One

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Formula C27H31NO3
IUPAC Name (1s,4s,5s,16s,19r,23r)-4,5,24,24-tetramethyl-25,26-dioxa-7-azaheptacyclo[21.2.1.0 1,20 .0 4,19 .0 5,16 .0 6,14 .0 8,13 ]hexacosa-6(14),8,10,12,20-pentaen-22-one
Molecular Mass 417.540 g·mol−1
Heat of Formation -333.9 ± 16.7 kJ·mol−1
Dipole Moment 2.28 ± 1.08 D
Volume 498.74 Å 3
Surface Area 388.67 Å 2
HOMO Energy -8.17 ± 0.55 eV
LUMO Energy 2.60 ± eV
Point Group Symmetry C1
InChIKey HSFKQYJRJBEWKH-XTHGXZEWSA-N
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